2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone

C15H27NO2 — CID 115276010

IUPAC2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone
SMILESCC1(C)CC(O)CCN1C(=O)CC1CCCCC1
InChIInChI=1S/C15H27NO2/c1-15(2)11-13(17)8-9-16(15)14(18)10-12-6-4-3-5-7-12/h12-13,17H,3-11H2,1-2H3
InChIKeyLHSBTWOPRAEZNW-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.72
Rot. Bonds2

About 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone

2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone (PubChem CID 115276010) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone
PubChem CID115276010
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone
SMILESCC1(C)CC(O)CCN1C(=O)CC1CCCCC1
InChIInChI=1S/C15H27NO2/c1-15(2)11-13(17)8-9-16(15)14(18)10-12-6-4-3-5-7-12/h12-13,17H,3-11H2,1-2H3
InChIKeyLHSBTWOPRAEZNW-UHFFFAOYSA-N
XLogP2.72
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone
CID 115276015
1-(4-amino-2,2-dimethylpiperidin-1-yl)-2-cyclopentylethanone
CID 115276154
2-cyclopentyl-1-(3-hydroxy-2,2-dimethylpyrrolidin-1-yl)ethanone
CID 115275051
2-cyclohexyl-1-(2,2-dimethylpiperazin-1-yl)ethanone
CID 65463150
1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)heptan-1-one
CID 115276032
1-(4-amino-2,2-dimethylpiperidin-1-yl)-3-cyclobutylpropan-1-one
CID 115276179
1-(4-amino-2,2-dimethylpyrrolidin-1-yl)-4-cyclopentylbutan-1-one
CID 115275751
2-cyclohexyl-1-(3,3-dimethylazetidin-1-yl)ethanone
CID 170787386
1-(4-amino-2,2-dimethylpiperidin-1-yl)propan-1-one
CID 83696910
2-cyclobutyl-1-[(3S)-3-hydroxypyrrolidin-1-yl]ethanone
CID 103745565
1-[2-(bromomethyl)-3-methylpyrrolidin-1-yl]-2-cyclohexylethanone
CID 102787745
1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)-4-(1H-pyrrol-2-yl)butan-1-one
CID 115276035

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone?
The IUPAC name of 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone (CID 115276010) is 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone is CC1(C)CC(O)CCN1C(=O)CC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone?
The InChIKey is LHSBTWOPRAEZNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-15(2)11-13(17)8-9-16(15)14(18)10-12-6-4-3-5-7-12/h12-13,17H,3-11H2,1-2H3.
What are the key properties of 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone?
2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone has a molecular weight of 253.39 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(4-hydroxy-2,2-dimethylpiperidin-1-yl)ethanone is sourced from PubChem (CID 115276010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).